| Canonical Smiles | CC(C#C[Si](C)(C)C)O |
|---|---|
| IUPAC Name | 4-trimethylsilylbut-3-yn-2-ol |
| InChIKey | HJJSDJHRTMFJLP-UHFFFAOYSA-N |
| INCHI | 1S/C7H14OSi/c1-7(8)5-6-9(2,3)4/h7-8H,1-4H3 |
| Isomeric SMILES | CC(C#C[Si](C)(C)C)O |
| WGK Germany | 3 |
| PubChem CID | 2760828 |
| Molecular Weight | 142.27 |
| Reaxy-Rn | 1923632 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Alcohols and polyols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Secondary alcohols |
| Alternative Parents | Trialkylsilanes Organic metalloid salts Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Trialkylsilane - Secondary alcohol - Organic metalloid salt - Hydrocarbon derivative - Organic salt - Organosilicon compound - Alkylsilane - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 H2119269 | Certificate of Analysis | Jun 12, 2024 | T162712 |
| H2119270 | Certificate of Analysis | Jun 12, 2024 | T162712 |
| H2119271 | Certificate of Analysis | Jun 12, 2024 | T162712 |
| L2417388 | Certificate of Analysis | Jun 12, 2024 | T162712 |
| Sensitivity | Heat sensitive ;Moisture sensitive ;Air sensitive |
|---|---|
| Refractive Index | 1.45 |
| Flash Point(°F) | 141.8 °F |
| Flash Point(°C) | 32°C(lit.) |
| Molecular Weight | 142.270 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 142.081 Da |
| Monoisotopic Mass | 142.081 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 143.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
